copper 5,15-diphenyl-10-(trifluoromethyl)porphyrin-22,24-diide

Systemtic Name: copper 5,15-diphenyl-10-(trifluoromethyl)porphyrin-22,24-diide Openeye Name: copper 5,15-diphenyl-10-(trifluoromethyl)porphyrin-22,24-diide CAS Name: copper 5,15-diphenyl-10-(trifluoromethyl)porphyrin-22,24-diide IUPAC Name: copper 5,15-diphenyl-10-(trifluoromethyl)porphyrin-22,24-diide Traditional Name: cupric 5,15-diphenyl-10-(trifluoromethyl)porphine-22,24-diide Formula: C33H19CuF3N4 MolecularWeight: 592.07197

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=CC4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C(F)(F)F)C7=CC=CC=C7)C=C4)[N-]3.[Cu+2]

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=CC4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C(F)(F)F)C7=CC=CC=C7)C=C4)[N-]3.[Cu+2]

InChI

InChI=1S/C33H19F3N4.Cu/c34-33(35,36)32-28-17-15-26(39-28)30(20-7-3-1-4-8-20)24-13-11-22(37-24)19-23-12-14-25(38-23)31(21-9-5-2-6-10-21)27-16-18-29(32)40-27;/h1-19H;/q-2;+2